Number of particles = 412 A = 1 Angstrom (basic length-scale) H0(1,1) = 18.4012 A H0(1,2) = 0 A H0(1,3) = 0 A H0(2,1) = 0 A H0(2,2) = 73.7047 A H0(2,3) = 0 A H0(3,1) = 0 A H0(3,2) = 0 A H0(3,3) = 3.60927 A .NO_VELOCITY. entry_count = 7 auxiliary[0] = id auxiliary[1] = v_mass_metal auxiliary[2] = v_csym_metal auxiliary[3] = v_particle_eng_metal 63.546000 Cu 0.0828827 0.0261071 2.47524e-17 226 63.546 1.02407 -3.42588 63.546000 Cu 0.16708 0.0213414 0.5 228 63.546 0.524634 -3.45172 63.546000 Cu 0.261916 0.0197531 1 230 63.546 0.575351 -3.49723 63.546000 Cu 0.382168 0.0391941 4.39776e-17 231 63.546 0.229571 -3.52135 63.546000 Cu 0.368271 0.0161354 0.5 232 63.546 3.87244 -3.40627 63.546000 Cu 0.284086 0.0424871 0.5 233 63.546 0.234101 -3.52459 63.546000 Cu 0.466861 0.0113094 4.92645e-18 234 63.546 9.10927 -3.32857 63.546000 Cu 0.582883 0.0261071 1 235 63.546 1.02407 -3.42588 63.546000 Cu 0.485814 0.0326964 0.5 237 63.546 0.636242 -3.46313 63.546000 Cu 0.761916 0.0197531 1 212 63.546 0.575351 -3.49723 63.546000 Cu 0.66708 0.0213414 0.5 213 63.546 0.524634 -3.45172 63.546000 Cu 0.784086 0.0424871 0.5 220 63.546 0.234101 -3.52459 63.546000 Cu 0.966861 0.0113094 1 214 63.546 9.10927 -3.32857 63.546000 Cu 0.868271 0.0161354 0.5 215 63.546 3.87244 -3.40627 63.546000 Cu 0.882168 0.0391941 1 222 63.546 0.229571 -3.52135 63.546000 Cu 0.985814 0.0326964 0.5 224 63.546 0.636242 -3.46313 63.546000 Cu 0.00192745 0.0566875 3.92915e-17 223 63.546 0.0720692 -3.52606 63.546000 Cu 0.189614 0.048182 1 227 63.546 0.239916 -3.52428 63.546000 Cu 0.0977941 0.0517675 0.5 229 63.546 0.0795801 -3.53249 63.546000 Cu 0.0195624 0.0810184 0.5 245 63.546 0.0062968 -3.53777 63.546000 Cu 0.114483 0.0767701 1 247 63.546 0.0296299 -3.539 63.546000 Cu 0.21097 0.071991 0.5 249 63.546 0.0290796 -3.54195 63.546000 Cu 0.305971 0.0671693 0 251 63.546 0.0342127 -3.53524 63.546000 Cu 0.327384 0.0907219 0.5 254 63.546 0.0143452 -3.53957 63.546000 Cu 0.423625 0.085839 1.70624e-17 252 63.546 0.0103411 -3.53678 63.546000 Cu 0.404438 0.0616188 0.5 253 63.546 0.06242 -3.52874 63.546000 Cu 0.501927 0.0566875 1.73027e-17 255 63.546 0.0720692 -3.52606 63.546000 Cu 0.597794 0.0517675 0.5 257 63.546 0.0795801 -3.53249 63.546000 Cu 0.519562 0.0810184 0.5 258 63.546 0.0062968 -3.53777 63.546000 Cu 0.689614 0.048182 1 218 63.546 0.239916 -3.52428 63.546000 Cu 0.71097 0.071991 0.5 221 63.546 0.0290796 -3.54195 63.546000 Cu 0.614483 0.0767701 1.20157e-19 256 63.546 0.0296299 -3.539 63.546000 Cu 0.805971 0.0671693 1 219 63.546 0.0342127 -3.53524 63.546000 Cu 0.904438 0.0616188 0.5 225 63.546 0.06242 -3.52874 63.546000 Cu 0.827384 0.0907219 0.5 241 63.546 0.0143452 -3.53957 63.546000 Cu 0.923625 0.085839 5.68345e-17 243 63.546 0.0103411 -3.53678 63.546000 Cu 0.0378764 0.10554 1.20157e-19 244 63.546 0.00584252 -3.53981 63.546000 Cu 0.134122 0.100735 0.5 250 63.546 0.00351475 -3.5408 63.546000 Cu 0.0574375 0.129621 0.5 267 63.546 0.000923832 -3.54039 63.546000 Cu 0.153454 0.124883 1 269 63.546 0.00206843 -3.53989 63.546000 Cu 0.230227 0.0961148 1 248 63.546 0.0111738 -3.53964 63.546000 Cu 0.250229 0.119881 0.5 271 63.546 0.00241161 -3.53927 63.546000 Cu 0.346479 0.114925 6.92107e-17 273 63.546 0.00346407 -3.53898 63.546000 Cu 0.365557 0.13911 0.5 276 63.546 0.000787105 -3.5398 63.546000 Cu 0.461325 0.134429 1 274 63.546 0.00137083 -3.53999 63.546000 Cu 0.442528 0.110083 0.5 275 63.546 0.00161494 -3.53956 63.546000 Cu 0.537876 0.10554 1.53801e-17 277 63.546 0.00584252 -3.53981 63.546000 Cu 0.557438 0.129621 0.5 279 63.546 0.000923832 -3.54039 63.546000 Cu 0.653454 0.124883 1.94415e-16 238 63.546 0.00206843 -3.53989 63.546000 Cu 0.730227 0.0961148 1.56205e-18 239 63.546 0.0111738 -3.53964 63.546000 Cu 0.750229 0.119881 0.5 242 63.546 0.00241161 -3.53927 63.546000 Cu 0.634122 0.100735 0.5 278 63.546 0.00351475 -3.5408 63.546000 Cu 0.846479 0.114925 1 240 63.546 0.00346407 -3.53898 63.546000 Cu 0.942528 0.110083 0.5 246 63.546 0.00161494 -3.53956 63.546000 Cu 0.865557 0.13911 0.5 263 63.546 0.000787105 -3.5398 63.546000 Cu 0.961325 0.134429 2.40315e-19 265 63.546 0.00137083 -3.53999 63.546000 Cu 0.0767745 0.153767 1 266 63.546 0.000646707 -3.54 63.546000 Cu 0.173185 0.148843 0.5 272 63.546 0.000524466 -3.53985 63.546000 Cu 0.0962548 0.177791 0.5 288 63.546 0.000118628 -3.53997 63.546000 Cu 0.192449 0.172956 9.02382e-17 290 63.546 0.000132482 -3.53976 63.546000 Cu 0.26942 0.143992 1.27006e-16 270 63.546 0.000591426 -3.53934 63.546000 Cu 0.288633 0.16811 0.5 292 63.546 0.000166945 -3.53984 63.546000 Cu 0.384591 0.163336 1 294 63.546 0.000244738 -3.54003 63.546000 Cu 0.499978 0.182658 0 295 63.546 0.000203549 -3.54004 63.546000 Cu 0.480716 0.158541 0.5 296 63.546 0.000249292 -3.54021 63.546000 Cu 0.403891 0.187444 0.5 297 63.546 5.50702e-05 -3.54014 63.546000 Cu 0.576775 0.153767 2.34307e-17 298 63.546 0.000646707 -3.54 63.546000 Cu 0.596255 0.177791 0.5 299 63.546 0.000118628 -3.53997 63.546000 Cu 0.692449 0.172956 1.36259e-16 259 63.546 0.000132482 -3.53976 63.546000 Cu 0.673185 0.148843 0.5 260 63.546 0.000524466 -3.53985 63.546000 Cu 0.76942 0.143992 1.06099e-16 261 63.546 0.000591426 -3.53934 63.546000 Cu 0.788633 0.16811 0.5 264 63.546 0.000166945 -3.53984 63.546000 Cu 0.999978 0.182658 1 286 63.546 0.000203549 -3.54004 63.546000 Cu 0.884591 0.163336 1.20157e-19 262 63.546 0.000244738 -3.54003 63.546000 Cu 0.980716 0.158541 0.5 268 63.546 0.000249292 -3.54021 63.546000 Cu 0.903891 0.187444 0.5 284 63.546 5.50702e-05 -3.54014 63.546000 Cu 0.115471 0.20188 2.40315e-19 287 63.546 2.29547e-05 -3.53989 63.546000 Cu 0.0192984 0.206714 0.5 289 63.546 3.13381e-05 -3.53998 63.546000 Cu 0.0384626 0.230798 1.20157e-19 308 63.546 1.79952e-06 -3.53991 63.546000 Cu 0.134661 0.225969 0.5 310 63.546 1.07004e-05 -3.53996 63.546000 Cu 0.307747 0.192255 2.64346e-18 291 63.546 4.23545e-05 -3.54 63.546000 Cu 0.211652 0.197044 0.5 293 63.546 5.65593e-05 -3.53996 63.546000 Cu 0.230811 0.221153 5.33499e-17 312 63.546 8.00805e-06 -3.54 63.546000 Cu 0.326949 0.216351 0.5 314 63.546 7.72848e-06 -3.54006 63.546000 Cu 0.423063 0.211547 1.70624e-17 316 63.546 3.77446e-05 -3.54003 63.546000 Cu 0.538463 0.230798 1 317 63.546 1.79952e-06 -3.53991 63.546000 Cu 0.519298 0.206714 0.5 318 63.546 3.13381e-05 -3.53998 63.546000 Cu 0.442276 0.235631 0.5 319 63.546 6.9036e-06 -3.53996 63.546000 Cu 0.730811 0.221153 1 280 63.546 8.00805e-06 -3.54 63.546000 Cu 0.711652 0.197044 0.5 281 63.546 5.65593e-05 -3.53996 63.546000 Cu 0.615471 0.20188 1.20157e-19 320 63.546 2.29547e-05 -3.53989 63.546000 Cu 0.634661 0.225969 0.5 321 63.546 1.07004e-05 -3.53996 63.546000 Cu 0.807747 0.192255 1.32894e-16 282 63.546 4.23545e-05 -3.54 63.546000 Cu 0.923063 0.211547 2.40315e-19 283 63.546 3.77446e-05 -3.54003 63.546000 Cu 0.826949 0.216351 0.5 285 63.546 7.72848e-06 -3.54006 63.546000 Cu 0.942276 0.235631 0.5 306 63.546 6.9036e-06 -3.53996 63.546000 Cu 0.153836 0.250061 3.00394e-17 309 63.546 2.28026e-05 -3.53999 63.546000 Cu 0.057638 0.254888 0.5 311 63.546 7.33579e-06 -3.53996 63.546000 Cu 0.0768678 0.278964 1.61612e-16 330 63.546 5.8692e-05 -3.54003 63.546000 Cu 0.172978 0.274167 0.5 332 63.546 1.14627e-05 -3.54004 63.546000 Cu 0.346099 0.240449 9.13196e-18 313 63.546 8.5361e-06 -3.53998 63.546000 Cu 0.249957 0.245255 0.5 315 63.546 1.25474e-06 -3.54003 63.546000 Cu 0.269124 0.269361 1.20157e-19 334 63.546 6.02668e-06 -3.53999 63.546000 Cu 0.365257 0.264548 0.5 336 63.546 1.82745e-05 -3.53995 63.546000 Cu 0.461454 0.259719 1 338 63.546 4.47839e-06 -3.53991 63.546000 Cu 0.576868 0.278964 1.3013e-16 339 63.546 5.8692e-05 -3.54003 63.546000 Cu 0.557638 0.254888 0.5 340 63.546 7.33579e-06 -3.53996 63.546000 Cu 0.480639 0.283804 0.5 341 63.546 2.92437e-05 -3.53998 63.546000 Cu 0.653836 0.250061 1 300 63.546 2.28026e-05 -3.53999 63.546000 Cu 0.769124 0.269361 6.96913e-17 301 63.546 6.02668e-06 -3.53999 63.546000 Cu 0.749957 0.245255 0.5 302 63.546 1.25474e-06 -3.54003 63.546000 Cu 0.672978 0.274167 0.5 303 63.546 1.14627e-05 -3.54004 63.546000 Cu 0.846099 0.240449 5.59934e-17 304 63.546 8.5361e-06 -3.53998 63.546000 Cu 0.961454 0.259719 1 305 63.546 4.47839e-06 -3.53991 63.546000 Cu 0.865257 0.264548 0.5 307 63.546 1.82745e-05 -3.53995 63.546000 Cu 0.980639 0.283804 0.5 328 63.546 2.92437e-05 -3.53998 63.546000 Cu 0.192189 0.298262 1 331 63.546 3.78183e-05 -3.54002 63.546000 Cu 0.0960522 0.303069 0.5 333 63.546 5.65454e-05 -3.54014 63.546000 Cu 0.0192543 0.331969 0.5 349 63.546 0.000246238 -3.54021 63.546000 Cu 0.115364 0.327175 8.53118e-18 351 63.546 0.000253454 -3.54004 63.546000 Cu 0.384456 0.288638 1 335 63.546 3.10677e-05 -3.53989 63.546000 Cu 0.288271 0.293471 0.5 337 63.546 5.60854e-05 -3.53996 63.546000 Cu 0.211291 0.322401 0.5 353 63.546 0.000188487 -3.53985 63.546000 Cu 0.307493 0.317563 1 355 63.546 0.000132298 -3.53976 63.546000 Cu 0.4037 0.312719 0.5 357 63.546 8.47309e-05 -3.53997 63.546000 Cu 0.499971 0.307858 1 359 63.546 0.000176582 -3.54004 63.546000 Cu 0.596052 0.303069 0.5 361 63.546 5.65454e-05 -3.54014 63.546000 Cu 0.519254 0.331969 0.5 362 63.546 0.000246238 -3.54021 63.546000 Cu 0.692189 0.298262 2.73959e-17 322 63.546 3.78183e-05 -3.54002 63.546000 Cu 0.788271 0.293471 0.5 324 63.546 5.60854e-05 -3.53996 63.546000 Cu 0.711291 0.322401 0.5 325 63.546 0.000188487 -3.53985 63.546000 Cu 0.615364 0.327175 0 360 63.546 0.000253454 -3.54004 63.546000 Cu 0.999971 0.307858 1.13549e-16 327 63.546 0.000176582 -3.54004 63.546000 Cu 0.807493 0.317563 1 323 63.546 0.000132298 -3.53976 63.546000 Cu 0.884456 0.288638 0 326 63.546 3.10677e-05 -3.53989 63.546000 Cu 0.9037 0.312719 0.5 329 63.546 8.47309e-05 -3.53997 63.546000 Cu 0.0386396 0.356078 2.2109e-17 348 63.546 0.00134651 -3.53998 63.546000 Cu 0.134401 0.351398 0.5 354 63.546 0.000799254 -3.53981 63.546000 Cu 0.0574569 0.380422 0.5 371 63.546 0.00165756 -3.53958 63.546000 Cu 0.153514 0.375579 3.00394e-17 373 63.546 0.00344384 -3.53899 63.546000 Cu 0.230549 0.346519 0 352 63.546 0.000595364 -3.53935 63.546000 Cu 0.326778 0.341667 0.5 358 63.546 0.000489461 -3.53986 63.546000 Cu 0.249755 0.370625 0.5 375 63.546 0.00241994 -3.53929 63.546000 Cu 0.34652 0.365625 0 377 63.546 0.00201035 -3.53987 63.546000 Cu 0.423177 0.336747 1 356 63.546 0.000566392 -3.54 63.546000 Cu 0.442547 0.360885 0.5 379 63.546 0.000921032 -3.54039 63.546000 Cu 0.53864 0.356078 1.20157e-19 381 63.546 0.00134651 -3.53998 63.546000 Cu 0.557457 0.380422 0.5 383 63.546 0.00165756 -3.53958 63.546000 Cu 0.653514 0.375579 8.80754e-17 342 63.546 0.00344384 -3.53899 63.546000 Cu 0.730549 0.346519 9.61259e-19 343 63.546 0.000595364 -3.53935 63.546000 Cu 0.749755 0.370625 0.5 346 63.546 0.00241994 -3.53929 63.546000 Cu 0.634401 0.351398 0.5 382 63.546 0.000799254 -3.53981 63.546000 Cu 0.84652 0.365625 8.97576e-17 344 63.546 0.00201035 -3.53987 63.546000 Cu 0.826778 0.341667 0.5 345 63.546 0.000489461 -3.53986 63.546000 Cu 0.923177 0.336747 1.08142e-16 347 63.546 0.000566392 -3.54 63.546000 Cu 0.942547 0.360885 0.5 350 63.546 0.000921032 -3.54039 63.546000 Cu 0.076346 0.404659 7.61798e-17 370 63.546 0.0102817 -3.53679 63.546000 Cu 0.172621 0.399778 0.5 376 63.546 0.0141746 -3.53956 63.546000 Cu 0.194011 0.42333 4.63808e-17 394 63.546 0.0337644 -3.5352 63.546000 Cu 0.269784 0.394385 1.86244e-17 374 63.546 0.0113108 -3.53963 63.546000 Cu 0.365872 0.38977 0.5 380 63.546 0.00356702 -3.5408 63.546000 Cu 0.289051 0.418505 0.5 396 63.546 0.0289096 -3.54196 63.546000 Cu 0.385519 0.413721 3.00394e-17 398 63.546 0.0302623 -3.53898 63.546000 Cu 0.462094 0.384963 3.00394e-17 378 63.546 0.0057151 -3.53981 63.546000 Cu 0.480439 0.409481 0.5 400 63.546 0.00641793 -3.53778 63.546000 Cu 0.576346 0.404659 1 402 63.546 0.0102817 -3.53679 63.546000 Cu 0.694011 0.42333 6.51253e-17 363 63.546 0.0337644 -3.5352 63.546000 Cu 0.672621 0.399778 0.5 364 63.546 0.0141746 -3.53956 63.546000 Cu 0.769784 0.394385 6.80091e-17 365 63.546 0.0113108 -3.53963 63.546000 Cu 0.789051 0.418505 0.5 368 63.546 0.0289096 -3.54196 63.546000 Cu 0.885519 0.413721 1 366 63.546 0.0302623 -3.53898 63.546000 Cu 0.865872 0.38977 0.5 367 63.546 0.00356702 -3.5408 63.546000 Cu 0.962094 0.384963 5.70748e-17 369 63.546 0.0057151 -3.53981 63.546000 Cu 0.980439 0.409481 0.5 372 63.546 0.00641793 -3.53778 63.546000 Cu 0.0955369 0.428875 0.5 392 63.546 0.0626082 -3.52872 63.546000 Cu 0.117809 0.451292 0 391 63.546 0.230268 -3.52132 63.546000 Cu 0.0141414 0.457795 0.5 393 63.546 0.63767 -3.46305 63.546000 Cu 0.131726 0.474346 0.5 410 63.546 3.86807 -3.40695 63.546000 Cu 0.332886 0.469144 0.5 208 63.546 0.523893 -3.45175 63.546000 Cu 0.310391 0.442305 0 395 63.546 0.24132 -3.52429 63.546000 Cu 0.215902 0.448001 0.5 397 63.546 0.233792 -3.52456 63.546000 Cu 0.238055 0.470728 1 411 63.546 0.573509 -3.49751 63.546000 Cu 0.595537 0.428875 0.5 403 63.546 0.0626082 -3.52872 63.546000 Cu 0.514141 0.457795 0.5 9 63.546 0.63767 -3.46305 63.546000 Cu 0.417109 0.464381 4.71017e-17 201 63.546 1.02293 -3.42574 63.546000 Cu 0.498065 0.433811 6.21214e-17 399 63.546 0.0725175 -3.52613 63.546000 Cu 0.402194 0.438725 0.5 401 63.546 0.0794742 -3.53245 63.546000 Cu 0.631726 0.474346 0.5 1 63.546 3.86807 -3.40695 63.546000 Cu 0.617809 0.451292 2.40315e-19 3 63.546 0.230268 -3.52132 63.546000 Cu 0.738055 0.470728 6.84897e-18 384 63.546 0.573509 -3.49751 63.546000 Cu 0.715902 0.448001 0.5 385 63.546 0.233792 -3.52456 63.546000 Cu 0.998065 0.433811 5.25088e-17 390 63.546 0.0725175 -3.52613 63.546000 Cu 0.810391 0.442305 1.86244e-17 386 63.546 0.24132 -3.52429 63.546000 Cu 0.917109 0.464381 0 387 63.546 1.02293 -3.42574 63.546000 Cu 0.902194 0.438725 0.5 388 63.546 0.0794742 -3.53245 63.546000 Cu 0.832886 0.469144 0.5 389 63.546 0.523893 -3.45175 63.546000 Cu 0.0331612 0.511081 1.20157e-19 2 63.546 9.13622 -3.32817 63.546000 Cu 0.131728 0.515838 0.5 5 63.546 3.86543 -3.40617 63.546000 Cu 0.0330762 0.47917 1 408 63.546 9.1097 -3.32854 63.546000 Cu 0.150303 0.495106 1.20157e-19 409 63.546 6.8056 -3.39309 63.546000 Cu 0.238088 0.519455 7.06526e-17 4 63.546 0.579308 -3.49714 63.546000 Cu 0.249169 0.495078 0.5 207 63.546 1.39588 -3.52342 63.546000 Cu 0.349393 0.495086 1 412 63.546 2.46335 -3.48038 63.546000 Cu 0.332922 0.520998 0.5 6 63.546 0.532512 -3.45128 63.546000 Cu 0.450105 0.495089 0.5 7 63.546 8.91088 -3.35552 63.546000 Cu 0.533161 0.511081 1.94655e-17 10 63.546 9.13622 -3.32817 63.546000 Cu 0.533076 0.47917 1 199 63.546 9.1097 -3.32854 63.546000 Cu 0.631728 0.515838 0.5 12 63.546 3.86543 -3.40617 63.546000 Cu 0.738088 0.519455 5.93578e-17 14 63.546 0.579308 -3.49714 63.546000 Cu 0.650303 0.495106 2.40315e-19 404 63.546 6.8056 -3.39309 63.546000 Cu 0.749169 0.495078 0.5 405 63.546 1.39588 -3.52342 63.546000 Cu 0.849393 0.495086 1.51518e-16 406 63.546 2.46335 -3.48038 63.546000 Cu 0.950105 0.495089 0.5 407 63.546 8.91088 -3.35552 63.546000 Cu 0.832922 0.520998 0.5 16 63.546 0.532512 -3.45128 63.546000 Cu 0.0142367 0.532455 0.5 20 63.546 0.635131 -3.46247 63.546000 Cu 0.117881 0.538925 1 22 63.546 0.234351 -3.52137 63.546000 Cu 0.193876 0.566913 1 23 63.546 0.0356469 -3.53503 63.546000 Cu 0.0955006 0.561349 0.5 25 63.546 0.0614272 -3.52888 63.546000 Cu 0.215872 0.542195 0.5 24 63.546 0.237131 -3.52421 63.546000 Cu 0.3103 0.547876 0 26 63.546 0.240336 -3.52369 63.546000 Cu 0.417048 0.525797 3.00394e-17 8 63.546 1.03727 -3.42551 63.546000 Cu 0.514237 0.532455 0.5 13 63.546 0.635131 -3.46247 63.546000 Cu 0.402073 0.55144 0.5 29 63.546 0.0835899 -3.53238 63.546000 Cu 0.497993 0.55641 1.20157e-19 30 63.546 0.0723425 -3.52594 63.546000 Cu 0.595501 0.561349 0.5 32 63.546 0.0614272 -3.52888 63.546000 Cu 0.617881 0.538925 0 11 63.546 0.234351 -3.52137 63.546000 Cu 0.715872 0.542195 0.5 17 63.546 0.237131 -3.52421 63.546000 Cu 0.693876 0.566913 1.20157e-19 34 63.546 0.0356469 -3.53503 63.546000 Cu 0.8103 0.547876 1.16433e-16 15 63.546 0.240336 -3.52369 63.546000 Cu 0.917048 0.525797 1.09343e-17 18 63.546 1.03727 -3.42551 63.546000 Cu 0.997993 0.55641 1 19 63.546 0.0723425 -3.52594 63.546000 Cu 0.902073 0.55144 0.5 21 63.546 0.0835899 -3.53238 63.546000 Cu 0.0762133 0.585556 3.00394e-17 42 63.546 0.0101292 -3.53685 63.546000 Cu 0.153294 0.614655 0 43 63.546 0.00308382 -3.53898 63.546000 Cu 0.172467 0.590463 0.5 44 63.546 0.0129598 -3.53966 63.546000 Cu 0.0572011 0.609782 0.5 45 63.546 0.00198581 -3.53958 63.546000 Cu 0.288827 0.571703 0.5 27 63.546 0.0301706 -3.54195 63.546000 Cu 0.385325 0.576464 1 28 63.546 0.02885 -3.53889 63.546000 Cu 0.269634 0.595839 1 46 63.546 0.0119274 -3.53964 63.546000 Cu 0.365649 0.600429 0.5 49 63.546 0.00349736 -3.54081 63.546000 Cu 0.576213 0.585556 1.20157e-19 31 63.546 0.0101292 -3.53685 63.546000 Cu 0.480256 0.580727 0.5 33 63.546 0.00643628 -3.53771 63.546000 Cu 0.461834 0.605238 1.04537e-17 50 63.546 0.00518389 -3.5398 63.546000 Cu 0.557201 0.609782 0.5 52 63.546 0.00198581 -3.53958 63.546000 Cu 0.769634 0.595839 1.2232e-16 35 63.546 0.0119274 -3.53964 63.546000 Cu 0.788827 0.571703 0.5 36 63.546 0.0301706 -3.54195 63.546000 Cu 0.672467 0.590463 0.5 37 63.546 0.0129598 -3.53966 63.546000 Cu 0.653294 0.614655 0 54 63.546 0.00308382 -3.53898 63.546000 Cu 0.885325 0.576464 1 38 63.546 0.02885 -3.53889 63.546000 Cu 0.961834 0.605238 8.07458e-17 39 63.546 0.00518389 -3.5398 63.546000 Cu 0.980256 0.580727 0.5 40 63.546 0.00643628 -3.53771 63.546000 Cu 0.865649 0.600429 0.5 41 63.546 0.00349736 -3.54081 63.546000 Cu 0.0383783 0.634121 1 62 63.546 0.000910806 -3.54 63.546000 Cu 0.115176 0.663073 1 63 63.546 0.000139673 -3.53996 63.546000 Cu 0.134135 0.638834 0.5 64 63.546 0.000810241 -3.53977 63.546000 Cu 0.0190526 0.658266 0.5 65 63.546 0.000191819 -3.54019 63.546000 Cu 0.249522 0.619609 0.5 47 63.546 0.00243399 -3.5393 63.546000 Cu 0.346277 0.624601 1.24964e-17 48 63.546 0.00212727 -3.53988 63.546000 Cu 0.230332 0.643725 0 66 63.546 0.000547352 -3.53936 63.546000 Cu 0.326623 0.648582 0.5 68 63.546 0.000446288 -3.53988 63.546000 Cu 0.538378 0.634121 0 51 63.546 0.000910806 -3.54 63.546000 Cu 0.442265 0.62932 0.5 53 63.546 0.000862039 -3.54038 63.546000 Cu 0.423046 0.653491 0 70 63.546 0.000610348 -3.54002 63.546000 Cu 0.519053 0.658266 0.5 72 63.546 0.000191819 -3.54019 63.546000 Cu 0.730332 0.643725 0 55 63.546 0.000547352 -3.53936 63.546000 Cu 0.749522 0.619609 0.5 56 63.546 0.00243399 -3.5393 63.546000 Cu 0.634135 0.638834 0.5 57 63.546 0.000810241 -3.53977 63.546000 Cu 0.615176 0.663073 1.15591e-16 74 63.546 0.000139673 -3.53996 63.546000 Cu 0.846277 0.624601 1 58 63.546 0.00212727 -3.53988 63.546000 Cu 0.923046 0.653491 2.10275e-17 59 63.546 0.000610348 -3.54002 63.546000 Cu 0.942265 0.62932 0.5 60 63.546 0.000862039 -3.54038 63.546000 Cu 0.826623 0.648582 0.5 61 63.546 0.000446288 -3.53988 63.546000 Cu 0.0768686 0.711403 1 83 63.546 3.09201e-05 -3.53993 63.546000 Cu 0.0960061 0.687228 0.5 84 63.546 4.01883e-05 -3.54001 63.546000 Cu 0.192151 0.692056 0 86 63.546 1.89579e-05 -3.53986 63.546000 Cu 0.307416 0.672715 0 67 63.546 0.00013078 -3.53969 63.546000 Cu 0.211204 0.66786 0.5 69 63.546 0.000181429 -3.53975 63.546000 Cu 0.288255 0.696872 0.5 88 63.546 2.79604e-05 -3.53981 63.546000 Cu 0.384443 0.701704 1.20157e-19 90 63.546 5.92948e-05 -3.53977 63.546000 Cu 0.499893 0.682432 4.54195e-17 71 63.546 0.000154374 -3.54002 63.546000 Cu 0.403632 0.677563 0.5 73 63.546 9.35997e-05 -3.53993 63.546000 Cu 0.596006 0.687228 0.5 77 63.546 4.01883e-05 -3.54001 63.546000 Cu 0.480661 0.706555 0.5 92 63.546 2.16054e-05 -3.53988 63.546000 Cu 0.576869 0.711403 7.47379e-17 94 63.546 3.09201e-05 -3.53993 63.546000 Cu 0.692151 0.692056 1 75 63.546 1.89579e-05 -3.53986 63.546000 Cu 0.711204 0.66786 0.5 76 63.546 0.000181429 -3.53975 63.546000 Cu 0.788255 0.696872 0.5 81 63.546 2.79604e-05 -3.53981 63.546000 Cu 0.807416 0.672715 1 78 63.546 0.00013078 -3.53969 63.546000 Cu 0.884443 0.701704 1.20157e-19 79 63.546 5.92948e-05 -3.53977 63.546000 Cu 0.903632 0.677563 0.5 80 63.546 9.35997e-05 -3.53993 63.546000 Cu 0.999893 0.682432 1 82 63.546 0.000154374 -3.54002 63.546000 Cu 0.980661 0.706555 0.5 85 63.546 2.16054e-05 -3.53988 63.546000 Cu 0.172992 0.716225 0.5 89 63.546 1.06786e-05 -3.53994 63.546000 Cu 0.0386023 0.759721 9.38429e-17 103 63.546 1.43905e-05 -3.53979 63.546000 Cu 0.0576948 0.735555 0.5 104 63.546 7.74846e-06 -3.53986 63.546000 Cu 0.153904 0.740393 1.51879e-16 106 63.546 1.44589e-05 -3.53989 63.546000 Cu 0.269167 0.721041 3.60472e-19 87 63.546 7.005e-06 -3.53988 63.546000 Cu 0.365348 0.725875 0.5 93 63.546 9.34575e-06 -3.53982 63.546000 Cu 0.250045 0.745217 0.5 108 63.546 9.26507e-07 -3.53989 63.546000 Cu 0.346185 0.750042 0 111 63.546 2.0306e-05 -3.53989 63.546000 Cu 0.461492 0.730719 1 91 63.546 1.28061e-05 -3.53978 63.546000 Cu 0.557695 0.735555 0.5 97 63.546 7.74846e-06 -3.53986 63.546000 Cu 0.442412 0.754887 0.5 113 63.546 1.65876e-05 -3.53986 63.546000 Cu 0.538602 0.759721 4.67412e-17 114 63.546 1.43905e-05 -3.53979 63.546000 Cu 0.653904 0.740393 4.02527e-17 95 63.546 1.44589e-05 -3.53989 63.546000 Cu 0.672992 0.716225 0.5 96 63.546 1.06786e-05 -3.53994 63.546000 Cu 0.769167 0.721041 1 98 63.546 7.005e-06 -3.53988 63.546000 Cu 0.750045 0.745217 0.5 101 63.546 9.26507e-07 -3.53989 63.546000 Cu 0.846185 0.750042 5.6474e-17 99 63.546 2.0306e-05 -3.53989 63.546000 Cu 0.865348 0.725875 0.5 100 63.546 9.34575e-06 -3.53982 63.546000 Cu 0.961492 0.730719 2.25896e-17 102 63.546 1.28061e-05 -3.53978 63.546000 Cu 0.942412 0.754887 0.5 105 63.546 1.65876e-05 -3.53986 63.546000 Cu 0.134741 0.764565 0.5 109 63.546 1.04763e-05 -3.53981 63.546000 Cu 0.0194214 0.783887 0.5 124 63.546 2.37449e-05 -3.53989 63.546000 Cu 0.115641 0.788738 2.3671e-17 126 63.546 6.46944e-05 -3.53978 63.546000 Cu 0.00016957 0.808011 1.23642e-16 123 63.546 0.000150571 -3.54001 63.546000 Cu 0.230922 0.769397 0 107 63.546 4.69932e-06 -3.53986 63.546000 Cu 0.327094 0.774218 0.5 110 63.546 1.02931e-05 -3.53992 63.546000 Cu 0.211825 0.793568 0.5 128 63.546 2.36762e-05 -3.53982 63.546000 Cu 0.307932 0.798389 7.35363e-17 130 63.546 1.50714e-05 -3.53987 63.546000 Cu 0.423219 0.779035 5.46716e-17 112 63.546 4.20629e-05 -3.53992 63.546000 Cu 0.519421 0.783887 0.5 117 63.546 2.37449e-05 -3.53989 63.546000 Cu 0.404064 0.803213 0.5 133 63.546 3.70823e-05 -3.54001 63.546000 Cu 0.50017 0.808011 1.4479e-16 134 63.546 0.000150571 -3.54001 63.546000 Cu 0.615641 0.788738 1.54042e-16 115 63.546 6.46944e-05 -3.53978 63.546000 Cu 0.634741 0.764565 0.5 116 63.546 1.04763e-05 -3.53981 63.546000 Cu 0.730922 0.769397 4.8063e-17 118 63.546 4.69932e-06 -3.53986 63.546000 Cu 0.711825 0.793568 0.5 121 63.546 2.36762e-05 -3.53982 63.546000 Cu 0.807932 0.798389 6.57261e-17 119 63.546 1.50714e-05 -3.53987 63.546000 Cu 0.827094 0.774218 0.5 120 63.546 1.02931e-05 -3.53992 63.546000 Cu 0.923219 0.779035 1.20157e-19 122 63.546 4.20629e-05 -3.53992 63.546000 Cu 0.904064 0.803213 0.5 125 63.546 3.70823e-05 -3.54001 63.546000 Cu 0.192659 0.817731 3.6648e-17 127 63.546 0.000130627 -3.53969 63.546000 Cu 0.0964287 0.812879 0.5 129 63.546 7.32206e-05 -3.53993 63.546000 Cu 0.0770132 0.836958 1.42987e-17 146 63.546 0.000567727 -3.54001 63.546000 Cu 0.173432 0.841866 0.5 148 63.546 0.000425143 -3.53988 63.546000 Cu 0.288873 0.82258 0.5 131 63.546 0.000161381 -3.53976 63.546000 Cu 0.38488 0.827368 8.1707e-18 132 63.546 0.000144517 -3.53998 63.546000 Cu 0.269709 0.846724 6.75285e-17 150 63.546 0.000533476 -3.53935 63.546000 Cu 0.36592 0.851609 0.5 153 63.546 0.000772503 -3.53976 63.546000 Cu 0.577013 0.836958 1 135 63.546 0.000567727 -3.54001 63.546000 Cu 0.596429 0.812879 0.5 136 63.546 7.32206e-05 -3.53993 63.546000 Cu 0.480996 0.83218 0.5 137 63.546 0.000180519 -3.54018 63.546000 Cu 0.46167 0.856327 1 154 63.546 0.00088219 -3.53999 63.546000 Cu 0.692659 0.817731 0 138 63.546 0.000130627 -3.53969 63.546000 Cu 0.769709 0.846724 0 139 63.546 0.000533476 -3.53935 63.546000 Cu 0.788873 0.82258 0.5 140 63.546 0.000161381 -3.53976 63.546000 Cu 0.673432 0.841866 0.5 141 63.546 0.000425143 -3.53988 63.546000 Cu 0.88488 0.827368 6.34431e-17 142 63.546 0.000144517 -3.53998 63.546000 Cu 0.96167 0.856327 1 143 63.546 0.00088219 -3.53999 63.546000 Cu 0.980996 0.83218 0.5 144 63.546 0.000180519 -3.54018 63.546000 Cu 0.86592 0.851609 0.5 145 63.546 0.000772503 -3.53976 63.546000 Cu 0.153749 0.865857 1 147 63.546 0.00207557 -3.53985 63.546000 Cu 0.0577765 0.861132 0.5 149 63.546 0.000818966 -3.54037 63.546000 Cu 0.038205 0.885222 1 166 63.546 0.00495291 -3.53979 63.546000 Cu 0.13439 0.890034 0.5 168 63.546 0.003482 -3.54082 63.546000 Cu 0.250513 0.870844 0.5 151 63.546 0.00245932 -3.53932 63.546000 Cu 0.346717 0.875796 1.01653e-16 152 63.546 0.00298762 -3.53899 63.546000 Cu 0.230358 0.894623 3.6648e-17 170 63.546 0.0118089 -3.53965 63.546000 Cu 0.327526 0.899993 0.5 172 63.546 0.0126942 -3.53966 63.546000 Cu 0.538205 0.885222 4.08535e-18 155 63.546 0.00495291 -3.53979 63.546000 Cu 0.557776 0.861132 0.5 156 63.546 0.000818966 -3.54037 63.546000 Cu 0.442821 0.880668 0.5 157 63.546 0.00189127 -3.53957 63.546000 Cu 0.653749 0.865857 2.40315e-19 158 63.546 0.00207557 -3.53985 63.546000 Cu 0.730358 0.894623 2.40315e-19 159 63.546 0.0118089 -3.53965 63.546000 Cu 0.750513 0.870844 0.5 160 63.546 0.00245932 -3.53932 63.546000 Cu 0.63439 0.890034 0.5 161 63.546 0.003482 -3.54082 63.546000 Cu 0.846717 0.875796 2.40315e-19 162 63.546 0.00298762 -3.53899 63.546000 Cu 0.942821 0.880668 0.5 164 63.546 0.00189127 -3.53957 63.546000 Cu 0.827526 0.899993 0.5 165 63.546 0.0126942 -3.53966 63.546000 Cu 0.114673 0.913994 1.20157e-19 167 63.546 0.0294595 -3.53888 63.546000 Cu 0.0197531 0.909732 0.5 169 63.546 0.00647398 -3.53769 63.546000 Cu 0.0979188 0.939025 0.5 188 63.546 0.083426 -3.53227 63.546000 Cu 0.189687 0.942589 1.27847e-16 190 63.546 0.241512 -3.52367 63.546000 Cu 0.00200434 0.934053 0 186 63.546 0.0722578 -3.52589 63.546000 Cu 0.306128 0.923552 5.5753e-17 171 63.546 0.0354356 -3.53503 63.546000 Cu 0.211162 0.918766 0.5 173 63.546 0.0296574 -3.54197 63.546000 Cu 0.28413 0.948273 0.5 192 63.546 0.2371 -3.52417 63.546000 Cu 0.38215 0.951542 1 194 63.546 0.232944 -3.52147 63.546000 Cu 0.423803 0.904897 4.56598e-18 174 63.546 0.00988629 -3.53681 63.546000 Cu 0.502004 0.934053 8.98777e-17 175 63.546 0.0722578 -3.52589 63.546000 Cu 0.519753 0.909732 0.5 176 63.546 0.00647398 -3.53769 63.546000 Cu 0.404499 0.929113 0.5 177 63.546 0.0613634 -3.52886 63.546000 Cu 0.597919 0.939025 0.5 181 63.546 0.083426 -3.53227 63.546000 Cu 0.614673 0.913994 3.06401e-17 178 63.546 0.0294595 -3.53888 63.546000 Cu 0.689687 0.942589 3.85705e-17 179 63.546 0.241512 -3.52367 63.546000 Cu 0.711162 0.918766 0.5 180 63.546 0.0296574 -3.54197 63.546000 Cu 0.78413 0.948273 0.5 185 63.546 0.2371 -3.52417 63.546000 Cu 0.923803 0.904897 8.05055e-17 163 63.546 0.00988629 -3.53681 63.546000 Cu 0.806128 0.923552 7.61798e-17 182 63.546 0.0354356 -3.53503 63.546000 Cu 0.88215 0.951542 8.23078e-17 183 63.546 0.232944 -3.52147 63.546000 Cu 0.904499 0.929113 0.5 184 63.546 0.0613634 -3.52886 63.546000 Cu 0.150585 0.995398 1 216 63.546 2.46286 -3.48016 63.546000 Cu 0.0498613 0.995396 0.5 217 63.546 8.91202 -3.35514 63.546000 Cu 0.0829177 0.964677 6.34431e-17 187 63.546 1.03535 -3.42521 63.546000 Cu 0.167056 0.969473 0.5 193 63.546 0.533627 -3.45109 63.546000 Cu 0.261904 0.971009 7.81023e-18 191 63.546 0.579342 -3.49748 63.546000 Cu 0.368258 0.974634 0.5 197 63.546 3.86321 -3.40709 63.546000 Cu 0.250809 0.995395 0.5 209 63.546 1.39675 -3.52345 63.546000 Cu 0.349677 0.995398 1.20157e-19 210 63.546 6.80144 -3.39331 63.546000 Cu 0.549861 0.995396 0.5 236 63.546 8.91202 -3.35514 63.546000 Cu 0.466845 0.979404 5.88771e-18 195 63.546 9.13584 -3.32801 63.546000 Cu 0.485765 0.958016 0.5 196 63.546 0.636058 -3.46269 63.546000 Cu 0.582918 0.964677 2.05469e-17 198 63.546 1.03535 -3.42521 63.546000 Cu 0.650585 0.995398 1 211 63.546 2.46286 -3.48016 63.546000 Cu 0.667056 0.969473 0.5 200 63.546 0.533627 -3.45109 63.546000 Cu 0.761904 0.971009 9.78081e-17 202 63.546 0.579342 -3.49748 63.546000 Cu 0.750809 0.995395 0.5 205 63.546 1.39675 -3.52345 63.546000 Cu 0.985765 0.958016 0.5 189 63.546 0.636058 -3.46269 63.546000 Cu 0.849677 0.995398 8.96374e-17 203 63.546 6.80144 -3.39331 63.546000 Cu 0.868258 0.974634 0.5 204 63.546 3.86321 -3.40709 63.546000 Cu 0.966845 0.979404 1 206 63.546 9.13584 -3.32801